SpectraBase Compound ID | AMKPTZHU52I |
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InChI | InChI=1S/C32H22N4O11S3.3Na/c37-24-16-11-20-3-1-5-25(48(39,40)41)28(20)30(24)35-33-22-12-7-18(8-13-22)19-9-14-23(15-10-19)34-36-31-27(50(45,46)47)17-21-4-2-6-26(49(42,43)44)29(21)32(31)38;;;/h1-17,37-38H,(H,39,40,41)(H,42,43,44)(H,45,46,47);;;/q;3*+1/p-3/b35-33+,36-34+;;; |
InChIKey | JVOLOVNUEVNTFN-BCYCOXNYSA-K |
Mol Weight | 800.67030785 g/mol |
Molecular Formula | C32H19N4Na3O11S3 |
Exact Mass | 799.990554 g/mol |
SpectraBase Spectrum ID | EcbSAxjwNdn |
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Name | 1,6-Naphthalenedisulfonic acid, 8-hydroxy-7-[[4'-[(2-hydroxy-8-sulfo-1-naphthalenyl)azo][1,1'-biphenyl]-4-yl]azo], trisodium salt |
CAS Registry Number | 6472-94-2 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C32H19N4Na3O11S3 |
InChI | InChI=1S/C32H22N4O11S3.3Na/c37-24-16-11-20-3-1-5-25(48(39,40)41)28(20)30(24)35-33-22-12-7-18(8-13-22)19-9-14-23(15-10-19)34-36-31-27(50(45,46)47)17-21-4-2-6-26(49(42,43)44)29(21)32(31)38;;;/h1-17,37-38H,(H,39,40,41)(H,42,43,44)(H,45,46,47);;;/q;3*+1/p-3/b35-33+,36-34+;;; |
InChIKey | JVOLOVNUEVNTFN-BCYCOXNYSA-K |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |